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How does rotoinversion combine rotation and inversion in a crystal?

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In crystallography, a rotoinversion is a compound symmetry element that combines a rotation about an axis with an inversion through a central point.12

During this process, the crystal is rotated by a specific angle—typically 360° divided by n—and then every atom is moved through a center of inversion to a new position. The resulting configuration must be identical to the crystal's original appearance for the symmetry to be present.12

Rotoinversion axes are categorized by the value of n (1, 2, 3, 4, or 6), which denotes the order of the operation:12

  • 1: Equivalent to a simple center of inversion.2
  • 2: Equivalent to a mirror plane.2
  • 3: Equivalent to a threefold rotation axis combined with a center of inversion.2
  • 4: Characterized by two top faces with identical faces inverted underneath.2
  • 6: Equivalent to a threefold rotation axis with a mirror plane perpendicular to that axis.2

These elements are fundamental to defining the 32 point groups that classify the internal atomic arrangements and external morphology of crystals.12